(1-butylpiperidin-4-yl)methyl 6-azanyl-5-chloranyl-2-methoxy-pyridine-3-carboxylate; ethanedioic acid

Systemtic Name: (1-butylpiperidin-4-yl)methyl 6-azanyl-5-chloranyl-2-methoxy-pyridine-3-carboxylate; ethanedioic acid Openeye Name: (1-butyl-4-piperidyl)methyl 6-amino-5-chloro-2-methoxy-pyridine-3-carboxylate; oxalic acid CAS Name: 6-amino-5-chloro-2-methoxy-3-pyridinecarboxylic acid (1-butyl-4-piperidinyl)methyl ester; oxalic acid IUPAC Name: (1-butylpiperidin-4-yl)methyl 6-amino-5-chloro-2-methoxypyridine-3-carboxylate; oxalic acid Traditional Name: 6-amino-5-chloro-2-methoxy-nicotinic acid (1-butyl-4-piperidyl)methyl ester; oxalic acid Formula: C19H28ClN3O7 MolecularWeight: 445.89452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)COC(=O)C2=CC(=C(N=C2OC)N)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCN1CCC(CC1)COC(=O)C2=CC(=C(N=C2OC)N)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H26ClN3O3.C2H2O4/c1-3-4-7-21-8-5-12(6-9-21)11-24-17(22)13-10-14(18)15(19)20-16(13)23-2;3-1(4)2(5)6/h10,12H,3-9,11H2,1-2H3,(H2,19,20);(H,3,4)(H,5,6)